* LIGAND DATABASE FILE (OPLS2005)
*
001      75    76    137    205     385
    1     0 S   NP   _N1_     1    29.09551    97.58392   -22.72039
    2     1 S   H    _HN1     2     1.02892    67.64350    28.98788
    3     1 S   H    _H1_     3     1.02898    46.95858   174.79542
    4     1 S   H    _H2_     4     1.02808    97.16248   -77.68871
    5     1 S   CT   _CA1     5     1.50238   148.84397   123.03663
    6     5 S   HC   _HA1     6     1.09692   104.85366    99.18719
    7     5 S   CO3  _C1_     7     1.54117   111.11528   -18.13582
    8     7 S   O2Z  _O11     8     1.26135   116.05765   -91.37395
    9     7 S   O2Z  _O12     9     1.26414   114.17803    86.86969
   10     5 S   CT   _CB1    10     1.53134   107.16699  -144.84313
   11    10 S   HC   HB11    11     1.09829   109.37109   -51.04805
   12    10 S   HC   HB12    12     1.09771   110.75455    65.63216
   13    10 S   CT   _CG1    13     1.52866   112.03448  -171.80133
   14    13 S   HC   HG11    14     1.09510   110.49479   -65.50053
   15    13 S   HC   HG12    15     1.09669   109.78480    53.61602
   16    13 S   C    _CD1    16     1.51718   112.65272   173.94294
   17    16 S   O    _OE1    17     1.22685   123.45685     1.85562
   18    16 S   N    _N2_    18     1.38566   111.35407  -177.92623
   19    18 S   H    _HN2    19     1.01588   118.86959     0.86773
   20    18 S   CT1  _CA2    20     1.46137   123.74581   177.51691
   21    20 S   HC   _HA2    21     1.09706   109.53066    -3.48751
   22    20 S   C    _C2_    22     1.53491   108.25015  -119.18647
   23    22 S   O    _O2_    23     1.23045   122.28768  -149.33594
   24    20 S   CT   _CB2    32     1.53199   111.18849   118.92719
   25    24 S   HC   HB21    33     1.09621   109.70232    55.50629
   26    24 S   HC   HB22    34     1.09502   110.77127   173.77408
   27    22 S   N    _N3_    24     1.38319   113.64078    37.96891
   28    27 S   H    _HN3    25     1.01614   119.51298    -3.44980
   29    24 S   S    _SG2    35     1.83000   111.56977   -66.65902
   30    27 S   CT   _CA3    26     1.45250   123.24360   177.96606
   31    30 S   HC   HA31    27     1.09544   107.61292   -63.53878
   32    30 S   HC   HA32    28     1.09564   107.86045    52.90156
   33    29 S   CA   _C10    36     1.79294    98.97906   146.84930
   34    30 S   CO3  _C3_    29     1.52957   114.07783   174.88664
   35    34 S   O2Z  _O31    30     1.26373   116.08975     3.34872
   36    34 S   O2Z  _O32    31     1.26434   114.40255  -176.70866
   37    33 S   CA   _C5_    37     1.40793   122.70501    82.57148
   38    37 S   CA   _C6_    38     1.40133   118.12044  -178.64564
   39    38 S   F    F6__    39     1.34182   119.97011   179.47961
   40    37 S   CT   _C4_    72     1.50330   122.57221     0.42104
   41    40 S   HC   _H5_    73     1.09417   110.32448   -69.23158
   42    40 S   HC   _H6_    74     1.09467   110.76642    52.40572
   43    40 S   HC   _H7_    75     1.09506   111.70901   171.16540
   44    38 S   CA   _C7_    40     1.39257   121.56590    -0.54212
   45    44 S   F    F5__    41     1.34125   118.85277  -179.69481
   46    44 S   CA   _C8_    42     1.39276   121.06582     0.28599
   47    33 S   CA   _C9_    43     1.40752   117.79534   -97.38917
   48    47 S   F    F1__    44     1.34435   119.27639    -1.50376
   49    46 S   CT   _C11    45     1.50353   120.92985  -179.18843
   50    49 S   HC   _H8_    46     1.09588   110.83109   -13.52247
   51    49 S   HC   _H9_    47     1.09628   109.24618   106.94147
   52    49 S   OS   _O33    48     1.43468   109.04845  -133.13623
   53    52 S   CO4  _C12    49     1.35854   116.00847   179.39607
   54    53 S   O    _O34    50     1.22242   126.70847    -4.81959
   55    53 S   C3T  _C13    51     1.48096   111.15074   176.46786
   56    55 S   HC   _H3_    52     1.08680   112.63988    95.90995
   57    55 S   C3T  _C14    53     1.51545   119.90559   -48.75933
   58    57 S   HC   _H4_    54     1.08723   117.46399    -4.66270
   59    55 S   C3T  _C15    55     1.51996   121.03889  -119.80701
   60    57 S   CM   _C18    64     1.47100   119.73842   138.16712
   61    60 S   HC   _H16    65     1.08888   114.92548   108.65897
   62    59 S   CT   _C16    56     1.51036   119.91893     3.70179
   63    62 S   HC   _H10    57     1.09497   110.29959   -79.97874
   64    62 S   HC   _H11    58     1.09495   110.25860   160.64021
   65    62 S   HC   _H12    59     1.09518   112.47546    40.67646
   66    59 S   CT   _C17    60     1.50997   116.77485  -139.14779
   67    66 S   HC   _H13    61     1.09526   110.15983    90.59464
   68    66 S   HC   _H14    62     1.09507   112.59979   -29.19381
   69    66 S   HC   _H15    63     1.09494   110.32226  -150.02314
   70    60 S   CM   _C19    66     1.34393   127.76879   -73.99937
   71    70 S   Cl   Cl1_    67     1.73365   121.33165     0.80259
   72    70 S   CT   _C20    68     1.49300   124.30835  -177.89383
   73    72 S   F    F2__    69     1.35796   111.61285   120.18260
   74    72 S   F    F3__    70     1.35836   113.01522     0.15451
   75    72 S   F    F4__    71     1.35794   111.86679  -120.08070
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
  12   2   1   1  11  10   4   5   2   1   1   8   3   7   5   1
   6   3   2   6   9   4  15   6  15   6  11   9   3   7   3   2
   1   3   2   1   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    47    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    46    47    48    40  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    46    47    48    49    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    47    48    40    41    42    43  
   39    44    45    46    47    49    40    41    42    43  
   44    45    46    40  
   41    42    43    44    47  
   42    43  
   43  
    0  
   45    46    47    48    49    50    51    52  
   46    47    49  
   47    48    49    50    51    52    53  
   48    49    50    51    52  
   49  
   50    51    52    53    54    55  
   51    52    53  
   52    53  
   53    54    55    56    57    59  
   54    55    56    57    58    59    62    66    60  
   55    56    57    59  
   56    57    58    59    62    63    64    65    66    67    68    69    60    61    70  
   57    58    59    62    66    60  
   58    59    62    63    64    65    66    67    68    69    60    61    70    71    72  
   59    62    66    60    61    70  
   62    63    64    65    66    67    68    69    60    61    70  
   61    70    71    72    73    74    75    62    66  
   70    71    72  
   63    64    65    66    67    68    69  
   64    65    66  
   65    66  
   66  
   67    68    69  
   68    69  
   69  
    0  
   71    72    73    74    75  
   72    73    74    75  
   73    74    75  
   74    75  
   75  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.320000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5500   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0700   0.130000   2.5000   1.7750   0.001000000  -0.843144165
   39   2.8500   0.0610  -0.130000   2.4980   2.2250   0.001000000   0.985400000
   40   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0700   0.130000   2.5000   1.7750   0.001000000  -0.843144165
   45   2.8500   0.0610  -0.130000   2.4980   2.2250   0.001000000   0.985400000
   46   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.220000   2.5000   1.7750   0.001000000  -0.843144165
   48   2.8500   0.0610  -0.220000   2.4980   2.2250   0.001000000   0.985400000
   49   3.5000   0.0660   0.231800   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   53   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   60   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   71   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   72   3.2500   0.0620   0.600000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
   74   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
   75   2.9400   0.0610  -0.200000   2.4980   2.2250   0.001000000   0.985400000
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   250.000  1.760
   33    37   469.000  1.400
   33    47   469.000  1.400
   37    38   469.000  1.400
   37    40   317.000  1.510
   38    39   420.000  1.354
   38    44   469.000  1.400
   44    45   420.000  1.354
   44    46   469.000  1.400
   46    47   469.000  1.400
   46    49   317.000  1.510
   47    48   420.000  1.354
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   320.000  1.410
   52    53   214.000  1.327
   53    54   570.000  1.229
   53    55   290.000  1.496
   55    56   340.000  1.088
   55    57   260.000  1.509
   55    59   260.000  1.509
   57    58   340.000  1.088
   57    59   260.000  1.509
   57    60   305.000  1.480
   59    62   275.000  1.510
   59    66   275.000  1.510
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   60    61   340.000  1.080
   60    70   549.000  1.340
   70    71   300.000  1.725
   70    72   317.000  1.510
   72    73   367.000  1.332
   72    74   367.000  1.332
   72    75   367.000  1.332
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    47    85.00000  119.40000
   33    37    38    63.00000  120.00000
   33    37    40    70.00000  120.00000
   33    47    46    63.00000  120.00000
   33    47    48    80.00000  120.00000
   37    38    39    80.00000  120.00000
   37    38    44    63.00000  120.00000
   37    40    41    35.00000  109.50000
   37    40    42    35.00000  109.50000
   37    40    43    35.00000  109.50000
   38    44    45    80.00000  120.00000
   38    44    46    63.00000  120.00000
   44    38    39    80.00000  120.00000
   44    46    47    63.00000  120.00000
   44    46    49    70.00000  120.00000
   46    44    45    80.00000  120.00000
   46    47    48    80.00000  120.00000
   46    49    50    35.00000  109.50000
   46    49    51    35.00000  109.50000
   46    49    52    85.00000  111.85700
   47    33    37    63.00000  120.00000
   49    46    47    70.00000  120.00000
   49    52    53    83.00000  116.90000
   51    49    50    33.00000  107.80000
   52    49    50    35.00000  109.50000
   52    49    51    35.00000  109.50000
   52    53    54    83.00000  123.40000
   52    53    55    81.00000  111.40000
   53    55    56    40.00000  116.18000
   53    55    57    65.00000  117.18000
   53    55    59    65.00000  117.18000
   55    53    54    75.00000  121.36600
   55    57    58    37.50000  117.20000
   55    57    59    10.00000   60.00500
   55    57    60    60.00000  120.58800
   55    59    57    10.00000   60.00500
   55    59    62    60.00000  120.94000
   55    59    66    60.00000  120.94000
   57    55    56    37.50000  117.20000
   57    59    62    60.00000  120.94000
   57    59    66    60.00000  120.94000
   57    60    61    40.00000  117.24000
   57    60    70    55.00000  125.06700
   59    55    56    37.50000  117.20000
   59    55    57    10.00000   60.00500
   59    57    58    37.50000  117.20000
   59    62    63    45.00000  109.38400
   59    62    64    45.00000  109.38400
   59    62    65    45.00000  109.38400
   59    66    67    45.00000  109.38400
   59    66    68    45.00000  109.38400
   59    66    69    45.00000  109.38400
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   66    59    62    58.35000  112.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   60    57    58    40.00000  112.45000
   60    57    59    60.00000  120.58800
   60    70    71    75.00000  121.50000
   60    70    72    70.00000  124.00000
   70    60    61    35.00000  120.00000
   70    72    73    85.00000  110.69400
   70    72    74    85.00000  110.69400
   70    72    75    85.00000  110.69400
   72    70    71    75.00000  111.02000
   74    72    73    77.00000  109.10000
   75    72    73    77.00000  109.10000
   75    72    74    77.00000  109.10000
   40    37    38    70.00000  120.00000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.63250 -1.0 2.0
   24    29    33    47   0.63250 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    37    40   3.62500 -1.0 2.0
   29    33    47    46   3.62500 -1.0 2.0
   29    33    47    48   3.62500 -1.0 2.0
   33    37    38    39   3.62500 -1.0 2.0
   33    37    38    44   3.62500 -1.0 2.0
   33    37    40    41   0.00000  1.0 1.0
   33    37    40    42   0.00000  1.0 1.0
   33    37    40    43   0.00000  1.0 1.0
   37    33    47    46   3.62500 -1.0 2.0
   37    33    47    48   3.62500 -1.0 2.0
   37    38    44    45   3.62500 -1.0 2.0
   37    38   -44    46   3.62500 -1.0 2.0
   38    37    40    41   0.00000  1.0 1.0
   38    37    40    42   0.00000  1.0 1.0
   38    37    40    43   0.00000  1.0 1.0
   38    44    46    47   3.62500 -1.0 2.0
   38    44    46    49   3.62500 -1.0 2.0
   39    38    44    45   3.62500 -1.0 2.0
   39    38    44    46   3.62500 -1.0 2.0
   44    46   -47    33   3.62500 -1.0 2.0
   44    46    47    48   3.62500 -1.0 2.0
   44    46    49    50   0.00000  1.0 1.0
   44    46    49    51   0.00000  1.0 1.0
   44    46    49    52   0.64500  1.0 1.0
   44    46    49    52   0.14800 -1.0 2.0
   44    46    49    52   0.20650  1.0 3.0
   45    44    46    47   3.62500 -1.0 2.0
   45    44    46    49   3.62500 -1.0 2.0
   46    49    52    53  -0.43900 -1.0 2.0
   46    49    52    53   0.14100  1.0 3.0
   47    33   -37    38   3.62500 -1.0 2.0
   47    33    37    40   3.62500 -1.0 2.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    51   0.00000  1.0 1.0
   47    46    49    52   0.64500  1.0 1.0
   47    46    49    52   0.14800 -1.0 2.0
   47    46    49    52   0.20650  1.0 3.0
   49    46    47    33   3.62500 -1.0 2.0
   49    46    47    48   3.62500 -1.0 2.0
   49    52    53    54   3.00000 -1.0 2.0
   49    52    53    55   1.63150  1.0 1.0
   49    52    53    55   2.92000 -1.0 2.0
   50    49    52    53   0.08050  1.0 3.0
   51    49    52    53   0.08050  1.0 3.0
   52    53    55    56   0.00000  1.0 1.0
   52    53    55    57   0.36750  1.0 3.0
   52    53    55    59   0.36750  1.0 3.0
   53    55    57    58   0.15000  1.0 3.0
   53    55   -57    59  -0.95700  1.0 1.0
   53    55   -57    59  -0.18200 -1.0 2.0
   53    55   -57    59   0.29450  1.0 3.0
   53    55    57    60  -0.98800  1.0 1.0
   53    55    57    60   0.48800 -1.0 2.0
   53    55    57    60   0.76800  1.0 3.0
   53    55   -59    57  -0.95700  1.0 1.0
   53    55   -59    57  -0.18200 -1.0 2.0
   53    55   -59    57   0.29450  1.0 3.0
   53    55    59    62  -0.95700  1.0 1.0
   53    55    59    62  -0.18200 -1.0 2.0
   53    55    59    62   0.29450  1.0 3.0
   53    55    59    66  -0.95700  1.0 1.0
   53    55    59    66  -0.18200 -1.0 2.0
   53    55    59    66   0.29450  1.0 3.0
   54    53    55    56   0.50000  1.0 3.0
   54    53    55    57   0.30150 -1.0 2.0
   54    53    55    59   0.30150 -1.0 2.0
   55    57   -59    62   0.07850  1.0 1.0
   55    57   -59    62  -0.03950 -1.0 2.0
   55    57   -59    62   0.67350  1.0 3.0
   55    57   -59    66   0.07850  1.0 1.0
   55    57   -59    66  -0.03950 -1.0 2.0
   55    57   -59    66   0.67350  1.0 3.0
   55    57    60    61   0.00000  1.0 1.0
   55    57    60    70   0.09850  1.0 1.0
   55    57    60    70   0.15250 -1.0 2.0
   55    57    60    70  -0.50650  1.0 3.0
   55    59    62    63   0.15000  1.0 3.0
   55    59    62    64   0.15000  1.0 3.0
   55    59    62    65   0.15000  1.0 3.0
   55    59    66    67   0.15000  1.0 3.0
   55    59    66    68   0.15000  1.0 3.0
   55    59    66    69   0.15000  1.0 3.0
   56    55    57    58   0.15000  1.0 3.0
   56    55   -57    59   0.15000  1.0 3.0
   56    55    57    60   0.15000  1.0 3.0
   56    55   -59    57   0.15000  1.0 3.0
   56    55    59    62   0.15000  1.0 3.0
   56    55    59    66   0.15000  1.0 3.0
   57    55   -59    62   0.07850  1.0 1.0
   57    55   -59    62  -0.03950 -1.0 2.0
   57    55   -59    62   0.67350  1.0 3.0
   57    55   -59    66   0.07850  1.0 1.0
   57    55   -59    66  -0.03950 -1.0 2.0
   57    55   -59    66   0.67350  1.0 3.0
   57    59    62    63   0.15000  1.0 3.0
   57    59    62    64   0.15000  1.0 3.0
   57    59    62    65   0.15000  1.0 3.0
   57    59    66    67   0.15000  1.0 3.0
   57    59    66    68   0.15000  1.0 3.0
   57    59    66    69   0.15000  1.0 3.0
   57    60    70    71   7.00000 -1.0 2.0
   57    60    70    72   7.00000 -1.0 2.0
   58    57   -59    55   0.15000  1.0 3.0
   58    57    59    62   0.15000  1.0 3.0
   58    57    59    66   0.15000  1.0 3.0
   58    57    60    61   0.33100  1.0 3.0
   58    57    60    70   0.00000  1.0 1.0
   59    55   -57    58   0.15000  1.0 3.0
   59    55   -57    60   0.34400  1.0 1.0
   59    55   -57    60   0.09450 -1.0 2.0
   59    55   -57    60   0.11100  1.0 3.0
   59    57    60    61   0.00000  1.0 1.0
   59    57    60    70   0.09850  1.0 1.0
   59    57    60    70   0.15250 -1.0 2.0
   59    57    60    70  -0.50650  1.0 3.0
   62    59    66    67   0.15000  1.0 3.0
   62    59    66    68   0.15000  1.0 3.0
   62    59    66    69   0.15000  1.0 3.0
   66    59    62    63   0.15000  1.0 3.0
   66    59    62    64   0.15000  1.0 3.0
   66    59    62    65   0.15000  1.0 3.0
   60    57   -59    55   0.34400  1.0 1.0
   60    57   -59    55   0.09450 -1.0 2.0
   60    57   -59    55   0.11100  1.0 3.0
   60    57    59    62   0.34400  1.0 1.0
   60    57    59    62   0.09450 -1.0 2.0
   60    57    59    62   0.11100  1.0 3.0
   60    57    59    66   0.34400  1.0 1.0
   60    57    59    66   0.09450 -1.0 2.0
   60    57    59    66   0.11100  1.0 3.0
   60    70    72    73   0.24700  1.0 1.0
   60    70    72    73   0.40650 -1.0 2.0
   60    70    72    73  -0.40300  1.0 3.0
   60    70    72    74   0.24700  1.0 1.0
   60    70    72    74   0.40650 -1.0 2.0
   60    70    72    74  -0.40300  1.0 3.0
   60    70    72    75   0.24700  1.0 1.0
   60    70    72    75   0.40650 -1.0 2.0
   60    70    72    75  -0.40300  1.0 3.0
   61    60    70    71   7.00000 -1.0 2.0
   61    60    70    72   7.00000 -1.0 2.0
   71    70    72    73   0.09700  1.0 1.0
   71    70    72    73   0.15600 -1.0 2.0
   71    70    72    73  -0.50800  1.0 3.0
   71    70    72    74   0.09700  1.0 1.0
   71    70    72    74   0.15600 -1.0 2.0
   71    70    72    74  -0.50800  1.0 3.0
   71    70    72    75   0.09700  1.0 1.0
   71    70    72    75   0.15600 -1.0 2.0
   71    70    72    75  -0.50800  1.0 3.0
   40    37    38    39   3.62500 -1.0 2.0
   40    37    38    44   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   37    47    33    29   4.00000 -1.0 2.0
   38    40    37    33   4.00000 -1.0 2.0
   44    39    38    37   4.00000 -1.0 2.0
   46    45    44    38   4.00000 -1.0 2.0
   47    49    46    44   4.00000 -1.0 2.0
   46    48    47    33   4.00000 -1.0 2.0
   52    55    53    54  10.50000 -1.0 2.0
   57    61    60    70  15.00000 -1.0 2.0
   72    71    70    60  15.00000 -1.0 2.0
END
